1-[[3,5-bis(chloranyl)pyridin-4-yl]methyl]-5-methoxy-2-(1-phenylethyl)-1H-isoquinoline

Systemtic Name: 1-[[3,5-bis(chloranyl)pyridin-4-yl]methyl]-5-methoxy-2-(1-phenylethyl)-1H-isoquinoline Openeye Name: 1-[(3,5-dichloro-4-pyridyl)methyl]-5-methoxy-2-(1-phenylethyl)-1H-isoquinoline CAS Name: 1-[(3,5-dichloro-4-pyridinyl)methyl]-5-methoxy-2-(1-phenylethyl)-1H-isoquinoline IUPAC Name: 1-[(3,5-dichloropyridin-4-yl)methyl]-5-methoxy-2-(1-phenylethyl)-1H-isoquinoline Traditional Name: 1-[(3,5-dichloro-4-pyridyl)methyl]-5-methoxy-2-(1-phenylethyl)-1H-isoquinoline Formula: C24H22Cl2N2O MolecularWeight: 425.35028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C=CC3=C(C2CC4=C(C=NC=C4Cl)Cl)C=CC=C3OC

Isomeric SMILES

CC(C1=CC=CC=C1)N2C=CC3=C(C2CC4=C(C=NC=C4Cl)Cl)C=CC=C3OC

InChI

InChI=1S/C24H22Cl2N2O/c1-16(17-7-4-3-5-8-17)28-12-11-19-18(9-6-10-24(19)29-2)23(28)13-20-21(25)14-27-15-22(20)26/h3-12,14-16,23H,13H2,1-2H3